SCHEMBL1832176

SCHEMBL1832176

CC(C)(c1ccccc1OCC(O)CS)c1ccccc1OCC(O)CS

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP1A2 P05177 3/20 0.45
LMNA P02545 3/20 0.45
KDM4E B2RXH2 2/20 0.45
AGTR1 P30556 1/20 0.45
ADRB2 P07550 2/20 0.43
ADRB1 P08588 1/20 0.43
ALOX15 P16050 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TP53 P04637 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
MAOA P21397 1/20 0.42
HTR2B P41595 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL868710 0.85 CYP1A2 (0.63) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL29690536 0.85 CYP1A2 (0.63) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL11496838 0.84 MAPT (0.54) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL10623325 0.83 CYP2D6 (0.55) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL3391824 0.81 LMNA (0.52) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL9585205 0.78 CYP1A2 (0.72) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL14837639 0.78 MAPT (0.48) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8439639 0.76 MAPT (0.46) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL869198 0.76 SMN1; SMN2 (0.46) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2
SCHEMBL29664528 0.75 MAPT (0.67) MAPTSMN1; SMN2ALDH1A1L3MBTL1CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1275668-B1 PHOTOCURABLE COMPOSITION, CURED OBJECT, AND PROCESS FOR PRODUCING THE SAME MITSUBISHI CHEM CORP (JP) 2011-05-11 EP disclosed
US-6759104-B2 LIQUID CRYSTALS DISPLAY; MIXTURE CONTAINING ACRYLATED ESTERS; PHOTOPOLYMERIZATION USING FREE RADICAL CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 2004-07-06 US disclosed
US-20030118941-A1 Photocurable composition, cured product and process for producing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2003-06-26 US disclosed
EP-1275668-A1 PHOTOCURABLE COMPOSITION, CURED OBJECT, AND PROCESS FOR PRODUCING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2003-01-15 EP disclosed